CAS Number
Molecular Formula
C50H48N12O4
Product format
Neat
Molecular Weight
881.01
Shipping
Room Temperature
API Family
Synonyms
2417548-76-4; 1-((R)-3-(5-(3-((R)-3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3, 4-d]pyrimidin-1-yl)piperidin-1-yl)-3-oxopropyl)-4-imino-3-(4-phenoxyphenyl)-4, 5-dihydro-1H-pyrazolo[3, 4-d]pyrimidin-1-yl)piperidin-1-yl)prop-2-en-1-one; 569ZVK5ZWY; CS-0164744; Z3486184140; 1-((R)-3-(5-(3-((R)-3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3, 4-d]pyrimidin-1-yl)piperidin-1-yl)-3-oxopropyl)-4-imino-3-(4-phenoxyphenyl)-4, 5-dihydro-1H-pyrazolo[3, 4-d]pyrimidin-1-yl)piperidin-1-yl)prop-2-en-1-one? (Ibrutinib Impurity pound(c); 1-[(3R)-3-(5-{3-[(3R)-3-{4-amino-3-[4-(phenyloxy)phenyl]pyrazolo[3, 4-d]pyrimidin-1-yl}hexahydropyridin-1-yl]-3-oxopropyl}-4-azanylidene-3-[4-(phenyloxy)phenyl]pyrazolo[3, 4-d]pyrimidin-1-yl)hexahydropyridin-1-yl]prop-2-en-1-one; 1-[(3R)-3-[5-[3-[(3R)-3-[4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3, 4-d]pyrimidin-1-yl]-1-piperidinyl]-3-oxopropyl]-4, 5-dihydro-4-imino-3-(4-phenoxyphenyl)-1H-pyrazolo[3, 4-d]pyrimidin-1-yl]-1-piperidinyl]-2-propen-1-one; 2-Propen-1-one, 1-[(3R)-3-[5-[3-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3, 4-d]pyrimidin-1-yl]-1-piperidinyl]-3-oxopropyl]-4, 5-dihydro-4-imino-3-(4-phenoxyphenyl)-1H-pyrazolo[3 and 4-d]pyrimidin-1-yl]-1-piperidinyl]-
Iupac Name
1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3, 4-d]pyrimidin-1-yl]piperidin-1-yl]-3-[4-imino-3-(4-phenoxyphenyl)-1-[(3R)-1-prop-2-enoylpiperidin-3-yl]pyrazolo[5 and 4-d]pyrimidin-5-yl]propan-1-one
InChI
InChI=1S/C50H48N12O4/c1-2-41(63)58-26-9-11-35(29-58)62-50-44(46(57-62)34-19-23-40(24-20-34)66-38-15-7-4-8-16-38)48(52)60(32-55-50)28-25-42(64)59-27-10-12-36(30-59)61-49-43(47(51)53-31-54-49)45(56-61)33-17-21-39(22-18-33)65-37-13-5-3-6-14-37/h2-8,13-24,31-32,35-36,52H,1,9-12,25-30H2,(H2,51,53,54)/t35-,36-/m1/s1
